SCHEMBL2093463

SCHEMBL2093463

[CH2]CCCOCCCCOCCCC

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.46
CYP3A4 P08684 2/20 0.44
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
CES2 O00748 1/20 0.38
HPGD P15428 1/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
USP2 O75604 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18998 0.97
SCHEMBL983991 0.94 MEN1 (0.52) TSHRMEN1THRBHTTKMT2A
SCHEMBL128554 0.94 TSHR (0.52) TSHRMEN1THRBHTTKMT2A
SCHEMBL6650487 0.94 TSHR (0.52) TSHRMEN1THRBHTTKMT2A
SCHEMBL1802869 0.94 TSHR (0.52) TSHRMEN1THRBHTTKMT2A
SCHEMBL816279 0.92 TSHR (0.50) TSHRMEN1THRBHTTKMT2A
SCHEMBL818096 0.92 TSHR (0.50) TSHRMEN1THRBHTTKMT2A
SCHEMBL816140 0.92 TSHR (0.50) TSHRMEN1THRBHTTKMT2A
SCHEMBL816971 0.92 TSHR (0.50) TSHRMEN1THRBHTTKMT2A
SCHEMBL815974 0.92 TSHR (0.50) TSHRMEN1THRBHTTKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9546234-B2 Metal fine particle dispersant, metal fine particle dispersion liquid, and cured film HARIMA CHEMICALS, INCORPORATED (JP) 2017-01-17 US disclosed
US-20160002379-A1 METAL FINE PARTICLE DISPERSANT, METAL FINE PARTICLE DISPERSION LIQUID, AND CURED FILM HARIMA CHEMICALS, INCORPORATED (JP) 2016-01-07 US disclosed
EP-2962750-A1 FINE METAL PARTICLE DISPERSANT, FINE METAL PARTICLE DISPERSED LIQUID, AND CURED FILM Harima Chemicals, Inc. (JP) 2016-01-06 EP disclosed
US-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 US disclosed
CN-100497345-C 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2009-06-10 CN disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
CN-1878777-A 2,3-dihydro-6-nitroimidazo (2,1-b) oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2006-12-13 CN disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed
US-4020048-A REACTING AN ALDEHYDE, A PHENOL, AND A CYCLOALIPHATIC POLYAMINE ROHM AND HAAS COMPANY (US) 1977-04-26 US disclosed
US-3962156-A ALDEHYDE-PHENOL-POLYAMINE REACTION PRODUCT ROHM AND HAAS COMPANY (US) 1976-06-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 TSHR 162/4885MEN1 4525/4885THRB 758/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.